4-methoxy-N-[[5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-methoxy-N-[[5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[[5-(2-anilino-2-oxo-ethyl)sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide CAS Name: N-[[5-[(2-anilino-2-oxoethyl)thio]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide IUPAC Name: N-[[5-(2-anilino-2-oxoethyl)sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide Traditional Name: N-[[5-[(2-anilino-2-keto-ethyl)thio]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Formula: C27H27N5O3S MolecularWeight: 501.59998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O3S/c1-35-23-14-12-21(13-15-23)26(34)28-18-24-30-31-27(32(24)17-16-20-8-4-2-5-9-20)36-19-25(33)29-22-10-6-3-7-11-22/h2-15H,16-19H2,1H3,(H,28,34)(H,29,33)